AG002SY6

26377-17-3 | 4-Pyridinepropanoic acid, β-oxo-, ethyl ester

AG002SY6

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CAS Number	26377-17-3
Catalog Number	AG002SY6(AGN-PC-0KK6Y3)
Chemical Name	4-Pyridinepropanoic acid, β-oxo-, ethyl ester
EC Number	247-635-1
IUPAC Name	ethyl 3-oxo-3-pyridin-4-ylpropanoate
InChI	InChI=1S/C10H11NO3/c1-2-14-10(13)7-9(12)8-3-5-11-6-4-8/h3-6H,2,7H2,1H3
InChI Key	PCJNYGPKMQQCPX-UHFFFAOYSA-N
MDL Number	MFCD00094021
Molecular Formula	C10H11NO3
Molecular Weight	193.1992
SMILES	C(=O)(CC(=O)OCC)c1ccncc1
Synonyms	ethyl isonicotinoylacetate, 26377-17-3, ethyl 3-oxo-3-(pyridin-4-yl)propanoate, ethyl 3-oxo-3-(4-pyridyl)propionate, Ethyl 3-(4-pyridyl)-3-oxopropionate, MFCD00094021, 3-Oxo-3-pyridin-4-yl-propionic acid ethyl ester, ethyl 3-oxo-3-pyridin-4-ylpropanoate, ethyl 3-oxo-3-(4-pyridinyl)propanoate, AK-23981, Ethyl isonicotinoylacetate, 95%, ethyl 3-oxo-3-(4-pyridyl)propanoate, EINECS 247-635-1, AC1MC2SG, ethyl-4-pyridoyl acetate, ethyl isonicotinoyl acetate, 2-isonicotinoylbutanoic acid, Ethyl (Isonicotinoyl)acetate, Oprea1_792658, KSC557O5J, SCHEMBL315471, CHEMBL2035667, CTK4F7754, DTXSID40180976, Ethyl ss-oxo-4-pyridinepropanoate, PCJNYGPKMQQCPX-UHFFFAOYSA-N, ZINC153760, Ethyl beta-oxo-4-pyridinepropanoate, Isonicotinoylacetic acid ethyl ester, ZX-AT005938, ZX-CM001636, 7598a, ANW-70637, BBL004913, OR5896, SBB010111, STL124112, AKOS000265392, (Isonicotinoyl)acetic Acid Ethyl Ester, CS-W002366, MCULE-7090871393, PB13020, PS-5517, RP03905, TRA0025715, VZ32208, ethyl 3-(4-pyridinyl)-3-oxopropionate, ethyl3-oxo-3-(pyridin-4-yl)propanoate, KS-000006I7, AC-28889, AJ-13080, AM803606, BP-11288, CC-28160, CJ-01287, Ethyl 3-(pyridin-4-yl)-3-oxopropanoate, SC-13410, SY017675, ZB005551, ethyl 3-oxo-3-(pyridin-4-yl)-propionate, AB0010305, AB1002677, AX8000113, DB-031052, DB-032212, TC-063231, A5241, BB 0218102, E1032, FT-0080185, FT-0638598, ST24033194, ST50410995, beta-Oxo-4-pyridinepropionic acid ethyl ester, 4-pyridinepropanoic acid, b-oxo-, ethyl ester, 4-Pyridinepropanoicacid, |A-oxo-, ethyl ester, C-5656, 3-Oxo-3-(4-pyridyl)propionic Acid Ethyl Ester, 3-Oxo-3-pyridin-4-ylpropionic acid ethyl ester, ETHYL 3-(PYRIDIN-4-YL)-3-OXOPROPIONATE, ETHYL 3-OXO-3-(PYRIDIN-4-YL)PROPIONATE, MFCD00094021 (95+%), 3-Oxo-3-(pyridin-4-yl)propanoic acid ethyl ester, 377E173, 4-Pyridinepropanoic acid, beta-oxo-, ethyl ester, C-08553, J-520898, I14-27013, Ethyl isonicotinylacetate, ETHYLISONICOTINOYLACETATE, C10H11NO3, C10-H11-N-O3, ZINC00153760, ACN-034758, CID2735202, Ethyl-3-oxo-3-(pyridin-4-yl)propanoate, Ethyl isonicotinoylacetate, 95% - 10G 10g, 829-45-8, N/A,

Complexity	209
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.074g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	193.202g/mol
Monoisotopic Mass	193.074g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	56.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number